3-(3-aminopropoxy)-N-ethylpropanamide

C8H18N2O2 — CID 62344045

IUPAC3-(3-aminopropoxy)-N-ethylpropanamide
SMILESCCNC(=O)CCOCCCN
InChIInChI=1S/C8H18N2O2/c1-2-10-8(11)4-7-12-6-3-5-9/h2-7,9H2,1H3,(H,10,11)
InChIKeyZNYXMKLUPFVTGQ-UHFFFAOYSA-N
MW174.24 g/mol
LogP-0.12
Rot. Bonds7

About 3-(3-aminopropoxy)-N-ethylpropanamide

3-(3-aminopropoxy)-N-ethylpropanamide (PubChem CID 62344045) has the molecular formula C8H18N2O2 and a molecular weight of 174.24 g/mol. Its IUPAC name is 3-(3-aminopropoxy)-N-ethylpropanamide.

Molecular Properties

Compound Name3-(3-aminopropoxy)-N-ethylpropanamide
PubChem CID62344045
Molecular FormulaC8H18N2O2
Molecular Weight174.24 g/mol
Exact Mass174.14
IUPAC Name3-(3-aminopropoxy)-N-ethylpropanamide
SMILESCCNC(=O)CCOCCCN
InChIInChI=1S/C8H18N2O2/c1-2-10-8(11)4-7-12-6-3-5-9/h2-7,9H2,1H3,(H,10,11)
InChIKeyZNYXMKLUPFVTGQ-UHFFFAOYSA-N
XLogP-0.12
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-aminoethoxy)-N-ethylpropanamide
CID 62343432
3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine
CID 158863461
N-[3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propyl]-3-ethoxypropanamide
CID 140926568
N-ethyl-3-octadecoxypropanamide
CID 169179965
N-ethyl-3-[2-(2-propoxyethoxy)ethoxy]propanamide
CID 144855445
3-ethoxy-N-ethylpropanamide
CID 58030283
N-ethyl-3-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanamide
CID 164717500
N-ethyl-3-[3-(propan-2-ylamino)propoxy]propanamide
CID 62342053
N-ethyl-3-[3-[3-(ethylamino)-3-oxopropoxy]-2-[[3-(ethylamino)-3-oxopropoxy]methyl]-2-methylpropoxy]propanamide
CID 134387196
4-amino-N-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide
CID 145188206
3-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-butylpropanamide
CID 171850519
3-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-propylpropanamide
CID 176761961

Frequently Asked Questions

What is the IUPAC name of 3-(3-aminopropoxy)-N-ethylpropanamide?
The IUPAC name of 3-(3-aminopropoxy)-N-ethylpropanamide (CID 62344045) is 3-(3-aminopropoxy)-N-ethylpropanamide.
What is the SMILES notation for 3-(3-aminopropoxy)-N-ethylpropanamide?
The canonical SMILES for 3-(3-aminopropoxy)-N-ethylpropanamide is CCNC(=O)CCOCCCN.
What is the InChIKey of 3-(3-aminopropoxy)-N-ethylpropanamide?
The InChIKey is ZNYXMKLUPFVTGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2/c1-2-10-8(11)4-7-12-6-3-5-9/h2-7,9H2,1H3,(H,10,11).
What are the key properties of 3-(3-aminopropoxy)-N-ethylpropanamide?
3-(3-aminopropoxy)-N-ethylpropanamide has a molecular weight of 174.24 g/mol, XLogP of -0.12, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-aminopropoxy)-N-ethylpropanamide is sourced from PubChem (CID 62344045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).